Zn complexed on hybrid manganese doped cobalt ferrite nanoparticles covered by silica as a catalyst in the synthesis of 2-amino-4H-pyran and N- arylquinoline derivatives.

In the present work, Zn complexed on hybrid manganese doped cobalt ferrite nanoparticles covered by silica were synthesized. These MNPs were characterized using different techniques including Fourier-transform infrared spectroscopy (FT-IR), X-ray diffraction analysis (XRD), Field emission-scanning electron micro-scope (FE-SEM), Energy-dispersive X-ray spectroscopy (EDS), Vibration sample magnetometer (VSM), Inductively coupled plasma atomic emission spectroscopy (ICP), Zeta potential and Thermogravimetric analysis (TGA). FE-SEM Images showed uniform spherical shape with rough surfaces and an aggregation in structure of MNPs. A decrease in Ms is visible in VSM analysis due to the increase in particle diameter as a result of loading the organic coating on the surface of the magnetic nanoparticles. According to TGA analysis, the synthesized MNPs have good stability up to 125 °C. The ICP analysis indicates the presence of 0.13 mmol/g zinc on the surface of loaded MNPs. The effect of these prepared MNPs as a catalyst was studied in the synthesis of 2-amino-4H-pyran and N- arylquinoline derivatives. This method provides excellent yield of products with short reaction time, simple purification and easy separation of the catalyst. Furthermore, the reusability of the catalyst during five periods was not associated with a significant decrease in its activity.

Synthesis of novel modified acrylamide copolymers for montmorillonite flocculants in water-based drilling fluid.

A study was conducted to treat the water-based drilling fluid through coagulation-flocculation. Innovative modified acrylamide copolymers were utilized as montmorillonite flocculants to improve drilling performance and reduce environmental contamination. A series of acrylamide copolymers was prepared by in situ free radical polymerization in aqueous medium using ammonium persulfate as a radical initiator. The chemical structure of the prepared copolymers was confirmed by FT-IR (Fourier-Transform Infrared Spectroscopy) and the polydispersity indices of the copolymers determined using gel permeation chromatography. Thermal gravimetric analysis showed that the copolymers have a very high temperature tolerance, i.e. they are stable up to 390 °C. In this paper, acrylamide copolymers were used as coagulant with cationic, anionic groups or both of them simultaneously. Consequently, in order to clarify the relationship between inhibitive properties, sedimentation volume measurement, SEM (scanning electron microscope), XRD (X-ray diffraction) and contact angle were adopted. Some factors including molecular weight and molecular chain affecting the interaction between copolymers and clay particles were analyzed. Anionic sample with the highest molecular weight can reduce the interlayer spacing of the hydrated clay to the minimum. Amphoteric sample exhibits the best performance as a coagulant in comparison with other copolymers.

Synthesis of water soluble ionic liquid copolymers based on acrylamide and investigation of their properties in flocculating of clay suspensions.

To overcome water absorption and swelling by clay mineral layers, it is very important to develop stabilizing additives for water-based drilling fluids, where organic polymers are used as raw materials. Acrylamide copolymers, acting as flocculating agents, have the potential to separate minerals such as montmorillonite. In this study, three water-soluble copolymers containing acrylamide-amphoter, acrylamide-amphoter-anion, and acrylamide-amphoter-cation were synthesized and characterized using various analytical techniques, including Fourier-transform infrared spectroscopy, nuclear magnetic resonance, gel permeation chromatography, differential scanning calorimetry, thermogravimetric analysis, and derivative thermal gravimetric techniques. These copolymers were employed as flocculants to treat water suspensions containing montmorillonite particles, and a range of analytical methods, such as sedimentation volume measurement, scanning electron microscopy analysis, X-ray diffraction analysis, and contact angle measurement, were employed to identify the relationship between inhibitive performance. The flocculation of montmorillonite plates was attributed to the electrostatic attractions between montmorillonite and the synthesized copolymers. High molecular weight copolymers offer greater thermal stability and better flocculation characteristics for water-based drilling fluids. Among the tested copolymers, the acrylamide-amphoter-anion sample, with the highest molecular weight, exhibited the best performance as a coagulant when compared to the other copolymers.

Synthesis of a novel porous organic polymer containing triazine and cyclohexanone rings as an efficient methyl red adsorbent from aqueous solutions.

In this research, a new porous organic polymer based on triazine and cyclohexanone rings was synthesized via Schiff base condensation, and its performance as an adsorbent for the removal of Methyl Red dye from aqueous solution was investigated. The synthesized polymer was characterized by FT-IR, XRD, SEM, EDS, TEM, TGA, and BET analyses. Five important parameters of pH (4-10), contact time (10-120 min), adsorbent dose (5-10 mg), initial dye concentration (10-70 mg/L), and temperature (25-45 °C) were investigated to optimize the adsorption conditions. Solution pH of 4, contact time of 80 min, adsorbent dose of 8 mg, initial dye concentration of 50 mg/L, and temperature of 45 °C were obtained as the best conditions for the adsorption of methyl red dye. Two widely used Langmuir and Freundlich models were employed to investigate the adsorption isotherm, and the obtained data showed that the adsorption process follows the Langmuir isotherm with a correlation coefficient (R2 = 0.9784) which indicates monolayer adsorption. The achieved maximum adsorption capacity was 178.57 mg/g. Also, the results of kinetic studies indicate that the adsorption process follows the pseudo-second-order kinetic, which suggests that chemical interactions play an important role in dye removal. Furthermore, the results showed that the adsorption process of methyl red dye by polymer is endothermic.

Synthesis and characterization of a novel N-rich porous organic polymer and its application as an efficient porous adsorbent for the removal of Pb(II) and Cd(II) ions from aqueous solutions.

In this study, a novel N-rich triazine-based porous organic polymer (NR-POP) was synthesized via Schiff-base condensation. The structure of the synthesized porous polymer was identified using FT-IR, XRD, SEM, EDS, TEM, TGA, and BET analyses. The adsorption efficiency of this polymer was investigated for the removal of lead and cadmium ions pollutants. The adsorption processes of Pb(II) and Cd(II) metal ions by this polymer adsorbent were exothermic and matched by the Langmuir isotherm with a high correlation coefficient (R2 = 0.9904, 0.9778), the maximum adsorption capacity (833.33, 178.57 mg g-1), and the pseudo-second-order kinetic model. Furthermore, NR-POP showed an excellent adsorption selectivity for Pb(II) compared to Cd(II).

Mono- and bis-pyrazolophthalazines: Design, synthesis, cytotoxic activity, DNA/HSA binding and molecular docking studies.

In an attempt to find new potent cytotoxic compounds, several mono- and bis-pyrazolophthalazines 4a-m and 6a-h were synthesized through an efficient, one-pot, three- and pseudo five-component synthetic approach. All derivatives were evaluated for their in vitro cytotoxic activities against four human cancer cell lines of A549, HepG2, MCF-7, and HT29. Compound 4e showed low toxicity against normal cell lines (MRC-5 and MCF 10A, IC50 > 200 µM) and excellent cytotoxic activity against A549 cell line with IC50 value of 1.25 ± 0.19 µM, which was 1.8 times more potent than doxorubicin (IC50 = 2.31 ± 0.13 µM). In addition, compound 6c exhibited remarkable cytotoxic activity against A549 and MCF-7 cell lines (IC50 = 1.35 ± 0.12 and 0.49 ± 0.01 µM, respectively), more than two-fold higher than that of doxorubicin. The binding properties of the best active mono- and bis-pyrazolophthalazine (4e and 6c) with HSA and DNA were fully evaluated by various techniques including UV-Vis absorption, circular dichroism (CD), Zeta potential and dynamic light scattering analyses indicating interaction of the compounds with the secondary structure of HSA and significant change of DNA conformation, presumably via a groove binding mechanism. Additionally, molecular docking and site-selective binding studies confirmed the fundamental interaction of compounds 4e and 6c with base pairs of DNA. Compounds 4e and 6c showed promising features to be considered as potential lead structures for further studies in cancer therapy.

Synthesis, characterization, anti-diabetic potential and DFT studies of 7-hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde oxime.

A new compound named 7-hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde oxime (7-Oxime) was synthesized and characterized by FT-IR, FT-Raman, 1H NMR and 13C NMR techniques. The conformer possibilities were studied to find the most stable conformer and its molecular geometry. Then, the dimer form of the most stable monomer was built and optimized. Density functional theory (DFT) B3LYP method with 6-311++G(d,p) basis set was applied to analyze the molecular electrostatic potential (MEP), HOMO and LUMO orbitals, the vibrational wavenumbers, the infrared intensities, the Raman scattering activities and several thermodynamic properties (at different temperatures). The stability of the molecule derived from hyperconjugative interactions and charge delocalization has been analyzed by using natural bond orbital (NBO) analysis. In order to find the possible inhibitory activity of 7-Oxime, an accurate molecular blind docking simulation was performed. The results indicated that the mentioned compound has a good binding affinity to interact with the active sites of human α-glucosidase and α-amylase. For the first time, our computational finding suggests that this compound has a potential to be used as a supplementary agent in the pre-management of diabetes mellitus.

A novel four- and pseudo-five-component reaction: unexpected efficient one-pot synthesis of 4H-thiopyran derivatives.

A facile and convenient novel method is reported for the synthesis of substituted 4H-thiopyrans by reacting aldehydes, malononitrile, carbon disulfide, and primary amines at room temperature in the presence of triethylamine as a catalyst. This reaction affords the desired products in high purity and has advantages of excellent yields, simple work-up procedure, and short reaction time.

Design and Synthesis of New Benzimidazole and Pyrimidine Derivatives as α-glucosidase Inhibitor.

In an endeavor to find a novel series of antihyperglycemic agents, new benzimidazole and pyrimidine derivatives were successfully synthesized efficiently in high yield with high purity, starting from amino acids in the presence of phosphorus oxychloride (POCl3). The synthesized compounds were identified by (1)H-NMR, (13)C-NMR, FT-IR spectroscopic techniques and elemental analysis. All products were assayed for their inhibitory effects on yeast and rat intestinal α-glucosidases. The results revealed that compounds with aromatic amino acids moiety showed significant inhibition activity on the tested enzymes. Among the benzimidazole derivatives 4c and 4d exhibited the best activity against both of the tested enzymes. Also, among the pyrimidine derivatives 5c and 5d possessed significant inhibition action on the enzymes. The IC50 values for the most potent benzimidazole yeast and intestinal α-glucosidases inhibitor (4d) were found to be 9.1 and 36.7 µM, respectively. The IC50 values for the inhibition of yeast and intestinal α-glucosidases by the most active pyrimidine compound (5d) were calculated to be 8.3 and 21.8 µM, respectively. Overall, this study proved that benzimidazole and pyrimidine derivatives with aromatic amino acids moieties can represent novel promising α-glucosidase inhibitors.

Synthesis and Antimicrobial Activity of some Tetrahydro Quinolone Diones and Pyrano[2,3-d]pyrimidine Derivatives.

There has been special interest in the chemistry of quinolone and pyrimidine derivatives due to their diverse biological activities such as anticonvulsant, anti-malarial agents, antibacterial, antiviral, cytostatic, antithelemintic, antigenotoxic, anti-cancer agents. These compounds are also used as targeting delayed-type hypersensivity and anti-convulsant agents. As a part of our research works in the synthesis of pyrimidine derivatives containing biological activities, a series of novel pyrano[2,3-d]pyrimidine derivatives 2 and tetrahydro quinolone dione derivatives 3 were synthesized via reaction of tetrahydrobenzo[b]pyrano derivatives 1 with different reagents in suitable yields. The characterization of these synthesized compounds was established by IR, (1)H NMR and (13)C NMR spectroscopic data. Furthermore, all compounds were subsequently evaluated for their in-vitro antibacterial activity against three bacteria: Staphylococcus aureus (ATTC-25923), Escherichia Coli (ATTC-25922) and Bacillus anthracic (ATTC-25924).

Synthesis of some novel chromenopyrimidine derivatives and evaluation of their biological activities.

Pyrimidine nucleosides are constituents of fundamental structure of the cells. There has been considerable attentions in the chemistry of pyrimidine derivatives due to having a wide range of biological activities such as antiviral, anti-malarial agents, cytostatic, antithelemintic, antibacterial, adenosine receptor ligands, anti-cancer agents, compounds targeting delayed-type hypersensivity and anti-convulsant agents. As a part of our research work in the synthesis of pyrimidines containing biological activities, a series of chromenopyrimidine derivatives were synthesized by reaction of an intermediate imine and ammonia derivatives in good to high yields. All synthesized compounds were characterized using IR and NMR ((1)H and (13)C) spectroscopy and elemental analysis data. The antibacterial activity of these compounds was investigated against Staphylococcus aureus (RTCC, 1885), and Escherichia Coli (ATCC, 35922).

Simple Synthesis and Biological Evaluation of Some Benzimidazoles Using Sodium Hexafluroaluminate, Na 3 AlF 6 , as an Efficient Catalyst.

Considerable attention has been focused on the synthesis of benzimidazoles due to having a broad spectrum of biological activities such as anti-parasitic, fungicidal, anti-thelemintic and anti-inflammatory activities. As a part of our research work in this area, a series of benzimidasole derivatives (3a-n) were synthesized in good to high yields by reaction of o-phenylenediamine and different aromatic aldehydes in the presence of sodium hexafluroaluminate, Na3AlF6, as an efficient catalyst at 50 (◦)C. This environmentally benign and practical method offers several advantages, such as high yields, use of available catalyst, mild reaction conditions and easy workup. The antibacterial activity of these benzimidasoles was also evaluated using Staphylococcus aureus (mm) and Escherichia coli (mm) bacterial strain. All synthesized materials were characterized using IR and NMR spectroscopy as well as microanalyses data.

Tetrabutylammonium Bromide in Water as a Green Media for the Synthesis of Pyrano[2,3-d]pyrimidinone and Tetrahydrobenzo[b]pyran Derivatives.

Tetrabutylammonium bromide (TBAB) was used as a green catalyst for the synthesis of tetrahydrobenzo[b]pyran and pyrano[2,3-d]pyrimidinone derivatives in water as a solvent. Use of nontoxic reaction components, short reaction times, easy work-up and high yields are some important advantages of this method.

A New Tetracycle from Dimerization of the N-Methylpyridazinium Ion in Aqueous Solution.

In a one-pot synthesis at room temperature the N-methylpyridazinium ion (1) dimerizes stereospecifically and with 100 % conversion in a series of OH- -catalyzed processes to give a new tetraazafluorene (2). Four of the individual steps can be identified directly and monitored by 1 H NMR spectroscopy.